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101132-09-6 | 1-Pyrrolidineacetonitrile, α-(1E)-1-propen-1-yl-
CAS No: 101132-09-6 Catalog No: AG0003TV MDL No:
Product Description
Catalog Number:
AG0003TV
Chemical Name:
1-Pyrrolidineacetonitrile, α-(1E)-1-propen-1-yl-
CAS Number:
101132-09-6
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
IUPAC Name:
2-(dimethylamino)but-3-enenitrile
InChI:
InChI=1S/C6H10N2/c1-4-6(5-7)8(2)3/h4,6H,1H2,2-3H3
InChI Key:
IDVOZACOBPEZAI-UHFFFAOYSA-N
SMILES:
C/C=C/C(N1CCCC1)C#N
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.16g/mol
Monoisotopic Mass:
110.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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